input word = C00053364

Metabolite InformationStructural formula
Name Isoglabrone
Formula C20H16O5
Mw 336.09977362
CAS RN 1115012-65-1
C_ID C00053364
InChIKey OAXGEVHOTKTLTP-UHFFFAOYSA-N
InChICode InChI=1S/C20H16O5/c1-20(2)8-7-13-17(25-20)6-5-14-18(23)15(10-24-19(13)14)12-4-3-11(21)9-16(12)22/h3-10,21-22H,1-2H3
SMILES CC1(C)C=Cc2c(ccc3c(=O)c(-c4ccc(O)cc4O)coc23)O1
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeFabaceaeGlycyrrhiza glabra Ref.
PlantaeFabaceaeGlycyrrhiza inflata Ref.
PlantaeFabaceaeGlycyrrhiza uralensis Ref.
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OrganismGlycyrrhiza glabra
ReferenceSong, W. et al., Anal. Chem., 89, (2017), 3146-3153.